TL;DR: 3-(4-Chloro-phenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-propionic acid (CAS 142994-19-2) is a chemical compound with molecular formula C24H20ClNO4 and molecular weight 421.1081 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-chlorophenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
Also Known As: Fmoc-D-4-Chlorophe, Fmoc-D-pClPhe-OH, Fmoc-4-chloro-D-phenylalanine, Fmoc-4-chloro-L-phenylalanine, fmoc-4-chlorophenylalanine
| Molecular Formula | C24H20ClNO4 |
| Molecular Weight | 421.1081 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 421.1081 Da |
| Heavy Atoms | 30 |
| Complexity | 584.0 |
| SMILES | C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CC4=CC=C(C=C4)Cl)C(=O)O |
| InChIKey | CQPNKLNINBUUOM-UHFFFAOYSA-N |
The XLogP value of 5.3 indicates that 3-(4-Chloro-phenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-propionic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Chloro-phenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-propionic acid. Following Lipinski's Rule of Five, 3-(4-Chloro-phenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-propionic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 3-(4-Chloro-phenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-propionic acid is 142994-19-2.
The molecular formula of 3-(4-Chloro-phenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-propionic acid is C24H20ClNO4.
The molecular weight of 3-(4-Chloro-phenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-propionic acid is 421.1081 g/mol.
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